Sulfuric Acid

Sulfuric Acid

SCHEMBL5315249

N=C(N)S.N=C(N)S.O=S(=O)(O)O

nearest known ligand 0.53

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Known targets — ChEMBL curated mechanism

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

The experimentally established mechanism targets of Sulfuric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.53
BLM P54132 2/20 0.53
CYP2D6 P10635 1/20 0.53
CYP2C19 P33261 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
CA5A P35218 2/20 0.46
CA5B Q9Y2D0 2/20 0.46
TSHR P16473 2/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
NT5E P21589 1/20 0.40
CA4 P22748 1/20 0.40
CA6 P23280 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
ALOX15 P16050 1/20 0.33
TDP1 Q9NUW8 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Sulfuric Acid SCHEMBL28217737 1.00 KDM4E (0.53) KDM4EBLMCYP2D6CYP2C19NPSR1
Sulfuric Acid SCHEMBL526776 1.00
Sulfuric Acid SCHEMBL27434030 0.90 KDM4E (0.52) KDM4EBLMCYP2D6CYP2C19NPSR1
Thiourea SCHEMBL933625 0.86
Sulfuric Acid SCHEMBL28148838 0.84 BLM (0.59) KDM4EBLMCYP2D6CYP2C19NPSR1
Sulfuric Acid SCHEMBL170524 0.84
Sulfuric Acid SCHEMBL1318239 0.84 BLM (0.59) KDM4EBLMCYP2D6CYP2C19NPSR1
Thiourea SCHEMBL28009945 0.83 KDM4E (0.46) KDM4EBLMCYP2D6CYP2C19NPSR1
Thiourea SCHEMBL28217736 0.81 KDM4E (0.38) KDM4EBLMCYP2D6CYP2C19NPSR1
Thiourea SCHEMBL8576993 0.81 BLM (0.43) KDM4EBLMCYP2D6CYP2C19NPSR1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 56 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115636773-B Aryl ester compound containing guanylurea or guanylester, and preparation and application thereof 中国农业大学 2023-11-17 CN claimed
CN-116444421-A Arylpiperidine compound containing guanidyl urea and preparation and application thereof 中国农业大学 2023-07-18 CN claimed
CN-115636773-B Aryl ester compound containing guanylurea or guanylester, and preparation and application thereof 中国农业大学 2023-11-17 CN disclosed
CN-116444421-A Arylpiperidine compound containing guanidyl urea and preparation and application thereof 中国农业大学 2023-07-18 CN disclosed
CN-114555586-B KRASG12C protein inhibitor and preparation method and application thereof 信达生物制药(苏州)有限公司 2023-06-23 CN disclosed
CN-115636773-A Aryl ester compound containing guanidinyl urea or guanidinyl ester and preparation and application thereof 中国农业大学 2023-01-24 CN disclosed
US-9546173-B2 Substituted pyrrolo[3,4-d]pyrimidines as kinase inhibitors NOVARTIS AG (CH) 2017-01-17 US disclosed
EP-2897961-B1 DIHYDROPYRROLIDINO-PYRIMIDINES AS KINASE INHIBITORS NOVARTIS AG (CH) 2016-10-26 EP disclosed
US-20150274733-A1 DIHYDROPYRROLIDINO-PYRIMIDINES AS KINASE INHIBITORS NOVARTIS AG (CH) 2015-10-01 US disclosed
CN-100575330-C Novel compounds ASTRAZENECA AB 2009-12-30 CN disclosed
WO-2007074391-A2 PREPARATION OF A KEY INTERMEDIATE IN THE SYNTHESIS OF ROSUVASTATIN KHAMAR BAKULESH MAFATLAL (IN) 2007-07-05 WO disclosed
US-4025527-A H-2 HISTAMINE RECEPTOR INHIBITORS SMITH KLINE & FRENCH LABORATORIES LIMITED (EN) 1977-05-24 US disclosed
US-4022797-A PHARMACEUTICALS SMITH KLINE & FRENCH LABORATORIES LIMITED (EN) 1977-05-10 US disclosed
US-4005202-A 5(6)-Benzene ring substituted benzimidazole-2-carbamate derivatives having anthelmintic activity SYNTEX (U.S.A.) INC. (US) 1977-01-25 US disclosed
US-4002640-A ANTIFUNGAL AGENTS SYNTEX (U.S.A.) INC. (US) 1977-01-11 US disclosed
US-4000302-A ANTIHISTAMINES SMITH KLINE & FRENCH LABORATORIES LIMITED (EN) 1976-12-28 US disclosed
US-3993768-A FUNGICIDES SYNTEX (U.S.A.) INC. (US) 1976-11-23 US disclosed
US-3965113-A 5(6)-Benzene ring substituted benzimidazole-2-carbamate derivatives having anthelmintic activity SYNTEX (U.S.A.) INC. (US) 1976-06-22 US disclosed
US-3962437-A 5(6)-Benzene ring substituted benzimidazole-2-carbamate derivatives having anthelmintic activity SYNTEX (U.S.A.) INC. (US) 1976-06-08 US disclosed
US-3935209-A 5(6)-Benzene ring substituted benzimidazole-2-carbamate derivatives having anthelmintic activity SYNTEX (U.S.A.) INC. (US) 1976-01-27 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150274733-A1 DIHYDROPYRROLIDINO-PYRIMIDINES AS KINASE INHIBITORS MAP3K1, MAP3K2, BRAF KDM4E 2333/4885BLM 3905/4885CYP2D6 1308/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.